N-methyl-4-pentyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide

Systemtic Name: N-methyl-4-pentyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide Openeye Name: N-methyl-N-(1-methyl-2-sulfanyl-ethyl)-4-pentyl-benzenesulfonamide CAS Name: N-(1-mercaptopropan-2-yl)-N-methyl-4-pentylbenzenesulfonamide IUPAC Name: N-methyl-4-pentyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide Traditional Name: 4-amyl-N-(2-mercapto-1-methyl-ethyl)-N-methyl-benzenesulfonamide Formula: C15H25NO2S2 MolecularWeight: 315.4945

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N(C)C(C)CS

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N(C)C(C)CS

InChI

InChI=1S/C15H25NO2S2/c1-4-5-6-7-14-8-10-15(11-9-14)20(17,18)16(3)13(2)12-19/h8-11,13,19H,4-7,12H2,1-3H3